112404-30-5
Product Name:
2-(2-(4-BROMOPHENYL)-2-OXOETHYL)-2,5,5-TRIMETHYLCYCLOHEXANE-1,3-DIONE
Formula:
C17H19BrO3
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 351.2 g/mol |
---|---|
XLogP3 | 3.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 350.05176 g/mol |
Monoisotopic Mass | 350.05176 g/mol |
Topological Polar Surface Area | 51.2 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 439 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |